2-(2-methyl-1,3-benzothiazol-6-yl)ethanoate

Systemtic Name: 2-(2-methyl-1,3-benzothiazol-6-yl)ethanoate Openeye Name: 2-(2-methyl-1,3-benzothiazol-6-yl)acetate CAS Name: 2-(2-methyl-1,3-benzothiazol-6-yl)acetate IUPAC Name: 2-(2-methyl-1,3-benzothiazol-6-yl)acetate Traditional Name: 2-(2-methyl-1,3-benzothiazol-6-yl)acetate Formula: C10H8NO2S- MolecularWeight: 206.24102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)CC(=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)CC(=O)[O-]

InChI

InChI=1S/C10H9NO2S/c1-6-11-8-3-2-7(5-10(12)13)4-9(8)14-6/h2-4H,5H2,1H3,(H,12,13)/p-1